2-(3-cyclohexyl-4-methoxyphenyl)morpholine

C17H25NO2 — CID 117440824

IUPAC2-(3-cyclohexyl-4-methoxyphenyl)morpholine
SMILESCOc1ccc(C2CNCCO2)cc1C1CCCCC1
InChIInChI=1S/C17H25NO2/c1-19-16-8-7-14(17-12-18-9-10-20-17)11-15(16)13-5-3-2-4-6-13/h7-8,11,13,17-18H,2-6,9-10,12H2,1H3
InChIKeyGZRJTZQBAZAUAU-UHFFFAOYSA-N
MW275.39 g/mol
LogP3.40
Rot. Bonds3

About 2-(3-cyclohexyl-4-methoxyphenyl)morpholine

2-(3-cyclohexyl-4-methoxyphenyl)morpholine (PubChem CID 117440824) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is 2-(3-cyclohexyl-4-methoxyphenyl)morpholine.

Molecular Properties

Compound Name2-(3-cyclohexyl-4-methoxyphenyl)morpholine
PubChem CID117440824
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC Name2-(3-cyclohexyl-4-methoxyphenyl)morpholine
SMILESCOc1ccc(C2CNCCO2)cc1C1CCCCC1
InChIInChI=1S/C17H25NO2/c1-19-16-8-7-14(17-12-18-9-10-20-17)11-15(16)13-5-3-2-4-6-13/h7-8,11,13,17-18H,2-6,9-10,12H2,1H3
InChIKeyGZRJTZQBAZAUAU-UHFFFAOYSA-N
XLogP3.40
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclohexyl-4-methoxyphenyl)morpholine?
The IUPAC name of 2-(3-cyclohexyl-4-methoxyphenyl)morpholine (CID 117440824) is 2-(3-cyclohexyl-4-methoxyphenyl)morpholine.
What is the SMILES notation for 2-(3-cyclohexyl-4-methoxyphenyl)morpholine?
The canonical SMILES for 2-(3-cyclohexyl-4-methoxyphenyl)morpholine is COc1ccc(C2CNCCO2)cc1C1CCCCC1.
What is the InChIKey of 2-(3-cyclohexyl-4-methoxyphenyl)morpholine?
The InChIKey is GZRJTZQBAZAUAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-19-16-8-7-14(17-12-18-9-10-20-17)11-15(16)13-5-3-2-4-6-13/h7-8,11,13,17-18H,2-6,9-10,12H2,1H3.
What are the key properties of 2-(3-cyclohexyl-4-methoxyphenyl)morpholine?
2-(3-cyclohexyl-4-methoxyphenyl)morpholine has a molecular weight of 275.39 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclohexyl-4-methoxyphenyl)morpholine is sourced from PubChem (CID 117440824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).